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4149-06-8,MFCD00003137
Catalog No.:AA003IR2
4149-06-8 | 3-AMINO-1-PHENYL-2-PYRAZOLIN-5-ONE
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$31.00   $22.00
- +
5g
97%
in stock  
$39.00   $27.00
- +
25g
>98.0%(T)(HPLC)
in stock  
$50.00   $35.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IR2
Chemical Name:
3-AMINO-1-PHENYL-2-PYRAZOLIN-5-ONE
CAS Number:
4149-06-8
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD00003137
IUPAC Name:
5-amino-2-phenyl-4H-pyrazol-3-one
InChI:
InChI=1S/C9H9N3O/c10-8-6-9(13)12(11-8)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11)
InChI Key:
LPOVZHYARSAVIZ-UHFFFAOYSA-N
SMILES:
O=C1CC(=NN1c1ccccc1)N
EC Number:
223-974-0
NSC Number:
3336
Properties
Computed Properties
 
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

Synonyms
 
3-amino-1-phenyl-4,5-dihydro-1H-pyrazol-5-one 
3-APDPO cpd 
5-Pyrazolone, 3-amino-1-phenyl- 
5-Amino-2-phenyl-2,4-dihydro-3H-pyrazol-3-one 
EINECS 223-974-0 
3H-Pyrazol-3-one, 2,4-dihydro-5-amino-2-phenyl- 
BRN 0153681 
AI3-61273 
2,4-Dihydro-5-amino-2-phenyl-3H-pyrazol-3-one 
5-AMINO-2,4-DIHYDRO-2-PHENYL-3H-PYRAZOL-3-ONE 
NSC3336 
ACMC-1AREY 
4149-06-8 
AC1Q6EYA 
AC1L2TU2 
TimTec1_001023 
CHEMBL1872892 
CTK4I4916 
LPOVZHYARSAVIZ-UHFFFAOYSA- 
DTXSID50194382 
LPOVZHYARSAVIZ-UHFFFAOYSA-N 
HMS1536O11 
HMS3078O03 
3-amino-1-phenyl-2-pyrazolin-5-one 
AC1Q5320 
KS-000016KG 
NSC-3336 
ZINC1559185 
ANW-13872 
BBL007908 
SBB003791 
STK387497 
1-Phenyl-3-amino-5(4H)-pyrazolone 
1-Phenyl-3-amino-2-pyrazolin-5-one 
3-Amino-1-phenyl-1H-pyrazol-5(4H)-one 
AKOS000119164 
AC-7642 
AN-8797 
MCULE-9247040081 
SDCCGMLS-0066224.P001 
VZ21631 
NCGC00174876-01 
AJ-27024 
AK-80302 
CJ-24504 
5-amino-2-phenyl-4H-pyrazol-3-one 
SMR001547208 
ST009462 
TS-02423 
1-Phenyl-3-amino-4,5-dihydropyrazol-5-on 
DB-049769 
LS-129010 
TC-102617 
ST24041724 
T8336 
V0896 
3H-Pyrazol-3-one, 5-amino-2,4-dihydro-2-phenyl- 
5-amino-2-phenyl-2,4-dihydro-pyrazol-3-one 
3-Amino-4,5-dihydro-1-phenyl-1H-pyrazol-5-one 
SR-01000597229 
3H-Pyrazol-3-one,5-amino-2,4-dihydro-2-phenyl- 
5-Amino-2-phenyl-2,4-dihydro-3H-pyrazol-3-one # 
S05-0133 
SR-01000597229-1 
BRD-K03635798-001-01-9 
F0347-2152 
Z256709746 
3-amino-1-phenyl-4,5-dihydro-1h-pyrazol-5-one 
InChI=1/C9H9N3O/c10-8-6-9(13)12(11-8)7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,11) 
N-benzyl-2-(3-cyclopentyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-1-yl)-N-methylacetamide 
3-Amino-1-phenyl-5-pyrazolone 
C9H9N3O 
CID77794 
AR-1F1700 
A1034 
3-Amino-1-phenyl-4,5-dihydropyrazolin-5-one 
28710-97-6 
4323-05-1 
MFCD00003137 
MLS002637685 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Synthesis and biological evaluation of a new class of acyl derivatives of 3-amino-1-phenyl-4,5-dihydro-1H-pyrazol-5-one as potential dual cyclooxygenase (COX-1 and COX-2) and human lipoxygenase (5-LOX) inhibitors.

Journal: Farmaco (Societa chimica italiana : 1989) 20050401

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